TX2
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
P | N4 | sing | 1.68Å | 1.61Å | |
P | O5' | sing | 1.61Å | 1.60Å | |
P | OP1 | doub | 1.48Å | 1.48Å | |
S | C8' | sing | 1.81Å | 1.83Å | |
S | HS | sing | 1.34Å | 1.30Å | |
N1 | C2 | sing | 1.35Å | 1.40Å | |
N1 | C6 | sing | 1.37Å | 1.40Å | |
N1 | C1' | sing | 1.47Å | 1.48Å | |
C2 | O2 | doub | 1.22Å | 1.23Å | |
C2 | N3 | sing | 1.35Å | 1.40Å | |
N3 | C4 | sing | 1.35Å | 1.40Å | |
N3 | HN3 | sing | 0.97Å | 1.00Å | |
C4 | O4 | doub | 1.22Å | 1.23Å | |
C4 | C5 | sing | 1.42Å | 1.40Å | |
N4 | C7' | sing | 1.47Å | 1.46Å | |
N4 | HN4 | sing | 1.01Å | 1.00Å | |
C5 | C6 | doub | 1.35Å | 1.39Å | |
C5 | C7 | sing | 1.51Å | 1.53Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
C7 | H7 | sing | 1.09Å | 1.10Å | |
C7 | H7A | sing | 1.09Å | 1.10Å | |
C7 | H7B | sing | 1.09Å | 1.10Å | |
C1' | C2' | sing | 1.54Å | 1.52Å | |
C1' | O4' | sing | 1.44Å | 1.43Å | |
C1' | H1' | sing | 1.09Å | 1.10Å | |
C2' | C3' | sing | 1.55Å | 1.53Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
C3' | O3' | sing | 1.43Å | 1.44Å | |
C3' | C4' | sing | 1.55Å | 1.54Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
O3' | HO3' | sing | 0.97Å | 0.95Å | |
C4' | O4' | sing | 1.44Å | 1.46Å | |
C4' | C5' | sing | 1.53Å | 1.54Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C5' | O5' | sing | 1.43Å | 1.44Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å | |
C7' | C8' | sing | 1.53Å | 1.53Å | |
C7' | H7' | sing | 1.09Å | 1.10Å | |
C7' | H7'A | sing | 1.09Å | 1.10Å | |
C8' | H8' | sing | 1.09Å | 1.10Å | |
C8' | H8'A | sing | 1.09Å | 1.10Å | |
P | OP3 | sing | 1.61Å | 1.72Å | |
OP3 | HOP3 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N4 | P | O5' | 110.9° | 109.5° |
N4 | P | OP1 | 111.1° | 109.4° |
P | N4 | C7' | 120.2° | 111.0° |
P | N4 | HN4 | 106.0° | 111.0° |
N4 | P | OP3 | 118.1° | 109.5° |
O5' | P | OP1 | 108.1° | 109.5° |
P | O5' | C5' | 116.4° | 123.0° |
O5' | P | OP3 | 115.3° | 109.5° |
OP1 | P | OP3 | 91.1° | 109.5° |
C8' | S | HS | 102.0° | 103.0° |
S | C8' | C7' | 112.1° | 109.5° |
S | C8' | H8' | 108.6° | 109.5° |
S | C8' | H8'A | 108.6° | 109.5° |
C2 | N1 | C6 | 119.8° | 120.6° |
C2 | N1 | C1' | 119.2° | 119.7° |
N1 | C2 | O2 | 120.3° | 119.5° |
N1 | C2 | N3 | 119.9° | 121.0° |
C6 | N1 | C1' | 121.0° | 119.7° |
N1 | C6 | C5 | 120.2° | 119.7° |
N1 | C6 | H6 | 119.9° | 120.1° |
N1 | C1' | C2' | 112.3° | 109.9° |
N1 | C1' | O4' | 110.1° | 109.9° |
N1 | C1' | H1' | 105.2° | 109.8° |
O2 | C2 | N3 | 119.8° | 119.5° |
C2 | N3 | C4 | 120.1° | 120.2° |
C2 | N3 | HN3 | 119.9° | 119.9° |
C4 | N3 | HN3 | 119.9° | 119.8° |
N3 | C4 | O4 | 119.1° | 120.3° |
N3 | C4 | C5 | 119.9° | 119.4° |
O4 | C4 | C5 | 120.9° | 120.3° |
C4 | C5 | C6 | 120.1° | 119.1° |
C4 | C5 | C7 | 120.2° | 120.4° |
C7' | N4 | HN4 | 106.1° | 111.0° |
N4 | C7' | C8' | 109.4° | 109.4° |
N4 | C7' | H7' | 109.5° | 109.5° |
N4 | C7' | H7'A | 109.5° | 109.4° |
C6 | C5 | C7 | 119.7° | 120.4° |
C5 | C6 | H6 | 119.9° | 120.2° |
C5 | C7 | H7 | 109.5° | 109.5° |
C5 | C7 | H7A | 109.5° | 109.5° |
C5 | C7 | H7B | 109.4° | 109.5° |
H7 | C7 | H7A | 109.4° | 109.4° |
H7 | C7 | H7B | 109.5° | 109.5° |
H7A | C7 | H7B | 109.5° | 109.5° |
C2' | C1' | O4' | 102.7° | 107.3° |
C2' | C1' | H1' | 112.3° | 109.9° |
C1' | C2' | C3' | 101.8° | 104.2° |
C1' | C2' | H2' | 112.1° | 110.5° |
C1' | C2' | H2'A | 112.1° | 110.6° |
O4' | C1' | H1' | 114.5° | 110.0° |
C1' | O4' | C4' | 104.9° | 106.9° |
C3' | C2' | H2' | 112.1° | 110.4° |
C3' | C2' | H2'A | 112.1° | 110.5° |
C2' | C3' | O3' | 110.8° | 110.9° |
C2' | C3' | C4' | 103.7° | 102.1° |
C2' | C3' | H3' | 112.0° | 110.9° |
H2' | C2' | H2'A | 106.7° | 110.5° |
O3' | C3' | C4' | 108.2° | 110.9° |
O3' | C3' | H3' | 107.8° | 110.8° |
C3' | O3' | HO3' | 109.5° | 114.0° |
C4' | C3' | H3' | 114.4° | 110.9° |
C3' | C4' | O4' | 106.1° | 103.5° |
C3' | C4' | C5' | 111.1° | 110.6° |
C3' | C4' | H4' | 111.7° | 110.6° |
O4' | C4' | C5' | 112.5° | 110.6° |
O4' | C4' | H4' | 110.4° | 110.7° |
C5' | C4' | H4' | 105.2° | 110.6° |
C4' | C5' | O5' | 113.1° | 109.5° |
C4' | C5' | H5' | 108.3° | 109.5° |
C4' | C5' | H5'A | 108.3° | 109.5° |
O5' | C5' | H5' | 108.3° | 109.4° |
O5' | C5' | H5'A | 108.3° | 109.5° |
H5' | C5' | H5'A | 110.6° | 109.5° |
C8' | C7' | H7' | 109.5° | 109.5° |
C8' | C7' | H7'A | 109.5° | 109.5° |
C7' | C8' | H8' | 108.6° | 109.4° |
C7' | C8' | H8'A | 108.6° | 109.5° |
H7' | C7' | H7'A | 109.4° | 109.5° |
H8' | C8' | H8'A | 110.4° | 109.5° |
P | OP3 | HOP3 | 109.5° | 114.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N4 | P | O5' | OP1 | 122.1° | 120.0° |
N4 | P | O5' | OP3 | 137.7° | 120.0° |
N4 | P | OP1 | OP3 | 120.9° | 120.0° |
P | N4 | C7' | HN4 | 120.0° | 123.9° |
N4 | P | O5' | C5' | 152.5° | 75.0° |
P | N4 | C7' | C8' | 141.3° | 135.0° |
P | N4 | C7' | H7' | 98.7° | 105.0° |
P | N4 | C7' | H7'A | 21.3° | 15.0° |
N4 | P | OP3 | HOP3 | 114.8° | 60.0° |
O5' | P | OP1 | OP3 | 117.2° | 120.0° |
O5' | P | N4 | C7' | 79.0° | 60.0° |
O5' | P | N4 | HN4 | 160.9° | 176.1° |
P | O5' | C5' | C4' | 126.9° | 180.0° |
P | O5' | C5' | H5' | 6.9° | 60.0° |
P | O5' | C5' | H5'A | 113.1° | 60.0° |
O5' | P | OP3 | HOP3 | 110.7° | 60.0° |
OP1 | P | N4 | C7' | 160.7° | 180.0° |
OP1 | P | N4 | HN4 | 40.7° | 56.1° |
OP1 | P | O5' | C5' | 30.4° | 45.0° |
OP1 | P | OP3 | HOP3 | 0.0° | 180.0° |
S | C8' | C7' | N4 | 156.8° | 180.0° |
S | C8' | C7' | H8' | 120.0° | 120.0° |
S | C8' | C7' | H8'A | 120.0° | 120.0° |
S | C8' | C7' | H7' | 83.2° | 60.0° |
S | C8' | C7' | H7'A | 36.8° | 60.1° |
S | C8' | H8' | H8'A | 118.9° | 120.0° |
HS | S | C8' | C7' | 180.0° | 179.9° |
HS | S | C8' | H8' | 60.0° | 60.0° |
HS | S | C8' | H8'A | 60.0° | 60.0° |
C2 | N1 | C6 | C1' | 179.9° | 179.7° |
N1 | C2 | O2 | N3 | 179.9° | 180.0° |
N1 | C2 | N3 | C4 | 0.1° | 0.0° |
N1 | C2 | N3 | HN3 | 179.9° | 180.0° |
C2 | N1 | C6 | C5 | 0.0° | 0.1° |
C2 | N1 | C6 | H6 | 180.0° | 180.0° |
C2 | N1 | C1' | C2' | 123.8° | 65.0° |
C2 | N1 | C1' | O4' | 122.5° | 52.9° |
C2 | N1 | C1' | H1' | 1.4° | 174.0° |
C6 | N1 | C2 | O2 | 179.9° | 179.9° |
C6 | N1 | C2 | N3 | 0.1° | 0.0° |
N1 | C6 | C5 | C4 | 0.1° | 0.1° |
N1 | C6 | C5 | H6 | 180.0° | 179.9° |
N1 | C6 | C5 | C7 | 180.0° | 179.9° |
C6 | N1 | C1' | C2' | 56.3° | 114.7° |
C6 | N1 | C1' | O4' | 57.4° | 127.5° |
C6 | N1 | C1' | H1' | 178.8° | 6.3° |
C1' | N1 | C2 | O2 | 0.1° | 0.3° |
C1' | N1 | C2 | N3 | 179.8° | 179.7° |
C1' | N1 | C6 | C5 | 179.9° | 179.8° |
C1' | N1 | C6 | H6 | 0.1° | 0.3° |
N1 | C1' | C2' | O4' | 118.2° | 119.4° |
N1 | C1' | C2' | H1' | 118.4° | 121.0° |
N1 | C1' | O4' | H1' | 118.3° | 121.0° |
N1 | C1' | C2' | C3' | 160.9° | 121.5° |
N1 | C1' | C2' | H2' | 79.2° | 119.9° |
N1 | C1' | C2' | H2'A | 40.8° | 2.8° |
N1 | C1' | O4' | C4' | 164.9° | 146.0° |
O2 | C2 | N3 | C4 | 180.0° | 180.0° |
O2 | C2 | N3 | HN3 | 0.0° | 0.0° |
C2 | N3 | C4 | HN3 | 180.0° | 180.0° |
C2 | N3 | C4 | O4 | 179.9° | 180.0° |
C2 | N3 | C4 | C5 | 0.0° | 0.0° |
N3 | C4 | O4 | C5 | 179.9° | 180.0° |
N3 | C4 | C5 | C6 | 0.1° | 0.1° |
N3 | C4 | C5 | C7 | 179.9° | 180.0° |
HN3 | N3 | C4 | O4 | 0.1° | 0.0° |
HN3 | N3 | C4 | C5 | 180.0° | 180.0° |
O4 | C4 | C5 | C6 | 179.8° | 180.0° |
O4 | C4 | C5 | C7 | 0.1° | 0.0° |
C4 | C5 | C6 | C7 | 179.9° | 180.0° |
C4 | C5 | C6 | H6 | 179.9° | 180.0° |
C4 | C5 | C7 | H7 | 180.0° | 0.0° |
C4 | C5 | C7 | H7A | 60.0° | 120.0° |
C4 | C5 | C7 | H7B | 60.0° | 120.0° |
N4 | C7' | C8' | H7' | 120.0° | 120.0° |
N4 | C7' | C8' | H7'A | 120.0° | 119.9° |
N4 | C7' | H7' | H7'A | 120.0° | 120.0° |
N4 | C7' | C8' | H8' | 83.2° | 60.0° |
N4 | C7' | C8' | H8'A | 36.9° | 60.0° |
C7' | N4 | P | OP3 | 57.4° | 60.0° |
HN4 | N4 | C7' | C8' | 21.3° | 11.1° |
HN4 | N4 | C7' | H7' | 141.3° | 131.1° |
HN4 | N4 | C7' | H7'A | 98.7° | 108.9° |
HN4 | N4 | P | OP3 | 62.7° | 63.9° |
C6 | C5 | C7 | H7 | 0.2° | 180.0° |
C6 | C5 | C7 | H7A | 120.1° | 60.0° |
C6 | C5 | C7 | H7B | 119.9° | 60.0° |
C7 | C5 | C6 | H6 | 0.0° | 0.0° |
C5 | C7 | H7 | H7A | 120.0° | 120.0° |
C5 | C7 | H7 | H7B | 120.0° | 120.0° |
C5 | C7 | H7A | H7B | 120.0° | 120.0° |
H7 | C7 | H7A | H7B | 120.0° | 120.0° |
C2' | C1' | O4' | H1' | 122.0° | 119.6° |
C1' | C2' | C3' | H2' | 120.0° | 118.6° |
C1' | C2' | C3' | H2'A | 120.0° | 118.8° |
C1' | C2' | H2' | H2'A | 123.1° | 122.7° |
C1' | C2' | C3' | O3' | 91.7° | 139.1° |
C1' | C2' | C3' | C4' | 24.1° | 20.8° |
C1' | C2' | C3' | H3' | 147.9° | 97.4° |
C2' | C1' | O4' | C4' | 45.1° | 26.6° |
O4' | C1' | C2' | C3' | 42.7° | 2.1° |
O4' | C1' | C2' | H2' | 162.7° | 120.7° |
O4' | C1' | C2' | H2'A | 77.3° | 116.6° |
C1' | O4' | C4' | C3' | 29.2° | 40.1° |
C1' | O4' | C4' | C5' | 150.9° | 158.6° |
C1' | O4' | C4' | H4' | 92.0° | 78.5° |
H1' | C1' | C2' | C3' | 80.7° | 117.5° |
H1' | C1' | C2' | H2' | 39.2° | 1.1° |
H1' | C1' | C2' | H2'A | 159.2° | 123.8° |
H1' | C1' | O4' | C4' | 76.9° | 93.0° |
C3' | C2' | H2' | H2'A | 123.1° | 122.6° |
C2' | C3' | O3' | C4' | 113.0° | 112.8° |
C2' | C3' | O3' | H3' | 122.8° | 123.6° |
C2' | C3' | C4' | H3' | 122.2° | 118.2° |
C2' | C3' | O3' | HO3' | 180.0° | 61.4° |
C2' | C3' | C4' | O4' | 1.9° | 37.0° |
C2' | C3' | C4' | C5' | 124.4° | 155.5° |
C2' | C3' | C4' | H4' | 118.4° | 81.6° |
H2' | C2' | C3' | O3' | 28.2° | 20.4° |
H2' | C2' | C3' | C4' | 144.1° | 97.8° |
H2' | C2' | C3' | H3' | 92.1° | 144.0° |
H2'A | C2' | C3' | O3' | 148.3° | 102.2° |
H2'A | C2' | C3' | C4' | 95.9° | 139.6° |
H2'A | C2' | C3' | H3' | 27.9° | 21.4° |
O3' | C3' | C4' | H3' | 120.1° | 123.6° |
O3' | C3' | C4' | O4' | 119.5° | 155.2° |
O3' | C3' | C4' | C5' | 117.9° | 86.3° |
O3' | C3' | C4' | H4' | 0.8° | 36.7° |
C4' | C3' | O3' | HO3' | 67.0° | 174.2° |
C3' | C4' | O4' | C5' | 121.7° | 118.5° |
C3' | C4' | O4' | H4' | 121.2° | 118.5° |
C3' | C4' | C5' | H4' | 121.1° | 122.9° |
C3' | C4' | C5' | O5' | 50.2° | 175.0° |
C3' | C4' | C5' | H5' | 170.2° | 55.0° |
C3' | C4' | C5' | H5'A | 69.8° | 65.0° |
H3' | C3' | O3' | HO3' | 57.2° | 62.2° |
H3' | C3' | C4' | O4' | 120.4° | 81.2° |
H3' | C3' | C4' | C5' | 2.2° | 37.3° |
H3' | C3' | C4' | H4' | 119.3° | 160.2° |
O4' | C4' | C5' | H4' | 120.2° | 123.0° |
O4' | C4' | C5' | O5' | 68.5° | 71.0° |
O4' | C4' | C5' | H5' | 51.5° | 169.1° |
O4' | C4' | C5' | H5'A | 171.5° | 49.1° |
C4' | C5' | O5' | H5' | 120.0° | 120.0° |
C4' | C5' | O5' | H5'A | 120.0° | 120.0° |
C4' | C5' | H5' | H5'A | 118.5° | 120.0° |
H4' | C4' | C5' | O5' | 171.3° | 52.0° |
H4' | C4' | C5' | H5' | 68.7° | 67.9° |
H4' | C4' | C5' | H5'A | 51.3° | 172.1° |
O5' | C5' | H5' | H5'A | 118.5° | 120.0° |
C5' | O5' | P | OP3 | 69.8° | 165.0° |
C8' | C7' | H7' | H7'A | 120.0° | 120.0° |
C7' | C8' | H8' | H8'A | 118.9° | 120.0° |
H7' | C7' | C8' | H8' | 36.8° | 60.0° |
H7' | C7' | C8' | H8'A | 156.9° | 180.0° |
H7'A | C7' | C8' | H8' | 156.8° | 180.0° |
H7'A | C7' | C8' | H8'A | 83.1° | 60.0° |